In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 18th, 2011 | 19 | No |
Popular Name: 1-[3-(4,5-dihydrothiazol-2-ylsulfanylmethyl)-2,4,6-trimethyl-phenyl]ethanone 1-[3-(4,5-dihydrothiazol-2-ylsul…
Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
---|---|---|---|---|---|---|---|---|---|---|
Ref Reference (pH 7) | 3.76 | 7.67 | -8.74 | 0 | 2 | 0 | 29 | 293.457 | 4 | ↓ |
Lo Low (pH 4.5-6) | 3.76 | 8.67 | -35.48 | 1 | 2 | 1 | 31 | 294.465 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.